1,2-Bis(2,4,6-tribromophenoxy)ethane - ≥98% , CAS No.37853-59-1

CAS: 37853-59-1 Cat. No.: B331608 Formula: C₁₄H₈Br₆O₂ Peso molecolare: 687.64 Numero EC: 253-692-3

GRADE & PURITY ≥98%

Synonyms

1,2-BIS(2,4,6-TRIBROMOPHENOXY)ETHANE | FireMaster FF 680 | 1,3,5-Tribromo-2-[2-(2,4,6-tribromophenoxy)ethoxy]benzene | FireMaster 680 | FF 680 | 1,1-(1,2-Ethanediylbis(oxy))bis(2,4,6-tribromobenzene) | BTBPE

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Panoramica

1,2-Bis(2,4,6-tribromophenoxy)ethane is a major "novel" brominated flame retardant (NBFRs) from various polymer materials.

Specifications

Sinonimi

1,2-BIS(2,4,6-TRIBROMOPHENOXY)ETHANE | FireMaster FF 680 | 1,3,5-Tribromo-2-[2-(2,4,6-tribromophenoxy)ethoxy]benzene | FireMaster 680 | FF 680 | 1,1-(1,2-Ethanediylbis(oxy))bis(2,4,6-tribromobenzene) | BTBPE

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Protected from light

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

504753561

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753561

Sorrisi canonici

C1=C(C=C(C(=C1Br)OCCOC2=C(C=C(C=C2Br)Br)Br)Br)Br

IUPAC Name

1,3,5-tribromo-2-[2-(2,4,6-tribromophenoxy)ethoxy]benzene

InChIKey

YATIGPZCMOYEGE-UHFFFAOYSA-N

INCHI

1S/C14H8Br6O2/c15-7-3-9(17)13(10(18)4-7)21-1-2-22-14-11(19)5-8(16)6-12(14)20/h3-6H,1-2H2

Isomeri SMILES

C1=C(C=C(C(=C1Br)OCCOC2=C(C=C(C=C2Br)Br)Br)Br)Br

Peso molecolare

687.64

Reaxy-Rn

3168887

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3168887&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Bromobenzenes Alkyl aryl ethers Aryl bromides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Halobenzene - Bromobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Solubilità: Soluble in chloroform, and water (0.2 mg/L at 25 °C).
• Sensibilità: light sensitive
• Punto di ebollizione (°C): ~566° C at 760 mmHg (Predicted)
• Punto di fusione (°C): 224-226° C
• Peso molecolare: 687.600 g/mol
• XLogP3: 7.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 687.556 Da
• Monoisotopic Mass: 681.562 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 291.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1